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Information card for entry 7110388
Preview
Coordinates | 7110388.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H34 O12 |
---|---|
Calculated formula | C23 H34 O12 |
SMILES | O1[C@H](O[C@@H]2O[C@@H]([C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]2OC(=O)C)COC(=O)C)[C@]([C@@H](C1)C)(C(=O)CC)C |
Title of publication | Practical radical cyclisations leading to the construction of near-stereopure quaternary carbon stereogenic centres |
Authors of publication | McCague, Raymond; Pritchard, Robin G.; Stoodley, Richard J.; Williamson, Douglas S. |
Journal of publication | Chemical Communications |
Year of publication | 1998 |
Journal issue | 24 |
Pages of publication | 2691 |
a | 6.425 ± 0.006 Å |
b | 23.566 ± 0.007 Å |
c | 17.545 ± 0.007 Å |
α | 90° |
β | 90.36 ± 0.04° |
γ | 90° |
Cell volume | 2656 ± 3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 3 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.2519 |
Residual factor for significantly intense reflections | 0.1276 |
Weighted residual factors for significantly intense reflections | 0.2426 |
Weighted residual factors for all reflections included in the refinement | 0.2893 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.34 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7110388.html
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Users of the data should acknowledge the original authors of the
structural data.